SCHEMBL8911935

SCHEMBL8911935

FC(F)(F)c1cc(-c2ccccc2)ccc1C=C1CCCCN1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 4/20 0.35
RXRB P28702 4/20 0.35
RXRG P48443 4/20 0.35
TNF P01375 1/20 0.35
IL6 P05231 1/20 0.35
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 2/20 0.35
NPC1 O15118 2/20 0.35
MAPT P10636 2/20 0.35
KMT2A Q03164 2/20 0.35
GAA P10253 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
HPGD P15428 3/20 0.33
PARP10 Q53GL7 2/20 0.33
PARP11 Q9NR21 2/20 0.33
DGAT1 O75907 1/20 0.33
KCNH2 Q12809 1/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28211015 0.82 TNF (0.51) TNFIL6MEN1KMT2AHPGD
SCHEMBL3855365 0.72 CYP26A1 (0.37) GAAPARP10PARP11ACHE
SCHEMBL8911116 0.70 PLAU (0.37) KDM4EMEN1NPC1MAPTKMT2A
SCHEMBL29004545 0.70 KIF11 (0.44) RXRARXRBRXRGDGAT1KCNH2
SCHEMBL16399474 0.70 KIF11 (0.47) RXRARXRBRXRGKDM4EMEN1
SCHEMBL2261719 0.67 CYP1A2 (0.41) MEN1NPC1MAPTKMT2AGAA
SCHEMBL2258288 0.67 CYP1A2 (0.41) MEN1NPC1MAPTKMT2AGAA
SCHEMBL8910275 0.67 TAAR1 (0.43) PARP10PARP11NOTUM
SCHEMBL11480321 0.66 CYP1A2 (0.40) MEN1NPC1MAPTKMT2AGAA
SCHEMBL11480324 0.66 CYP1A2 (0.40) MEN1NPC1MAPTKMT2AGAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5683998-A ANTIINFLAMMATORY AGENTS, ANTIALLERGENS, ANTIPAF AGENTS TORAY INDUSTRIES, INC. (JP) 1997-11-04 US disclosed